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MolNFT v1 · #184536 · protein

Src kinase domain in complex with ponatinib

7OTE: “Src kinase domain in complex with ponatinib”. X-ray diffraction, 1 ligand (0LI). MolNFT v1 #184536 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7OTE
Type
protein
Length
518 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P12931
Ligands
0LI

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B—protein259—P12931

Ligands and binding sites

  • 0LI · 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-{4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl) phenyl}benzamide · ligand · 2 copies · chains A, B
  • GOL · Glycerol · additive · 10 copies · chains A, B
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 7OTE · Src Kinase Domain in complex with ponatinib · the same entry in another collection · chain A against A, TM-score 1.00

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